#MD System 2.0 @Title neb0_image06 @Columns AsymmetricAtom AtomicNumber int 0 Connections string {{}} Fractional double {{0.0 0.0 0.0}} Name string {{}} Site int 1 WyckoffPosition int -1 @end @data 7 {} {0.286108343127 0.462087439675 0.520245372051} N1 1 1 14 {} {0.354765912907 0.576965324264 0.540858396091} Si1 2 1 14 {} {0.170923807975 0.472633099169 0.496211955902} Si2 3 1 14 {} {0.331109002286 0.326898437791 0.52531254768} Si3 4 1 8 {} {0.427764325462 0.596620960604 0.437661056917} O 5 1 1 {} {0.296289725557 0.676557179621 0.553857322634} H1 6 1 1 {} {0.414036249757 0.557831358705 0.638322056598} H2 7 1 1 {} {0.146679096381 0.593198327293 0.493535056523} H3 8 1 1 {} {0.119769331268 0.415358887359 0.586379727883} H4 9 1 1 {} {0.146586216665 0.420011522366 0.387482949381} H5 10 1 1 {} {0.393344493389 0.30638528866 0.430266465273} H6 11 1 1 {} {0.255100583975 0.246799542855 0.517324677321} H7 12 1 1 {} {0.380720235724 0.309183318298 0.63170723621} H8 13 1 1 {} {0.404706634777 0.618177305251 0.365165440325} H10 14 1 7 {} {0.748023490915 0.490581378662 0.550252866789} N3 15 1 14 {} {0.708496607435 0.473167774201 0.413933618239} Si4 16 1 14 {} {0.851174153252 0.551816527647 0.577436723375} Si5 17 1 14 {} {0.68351632821 0.440042982915 0.660742972991} Si6 18 1 7 {} {0.596022136876 0.448072525849 0.41721215999} N4 19 1 1 {} {0.733400280315 0.576127096146 0.350835781472} H11 20 1 1 {} {0.749656674106 0.373557140847 0.359459429478} H12 21 1 1 {} {0.89590708811 0.574511958514 0.468343487493} H13 22 1 1 {} {0.909609308126 0.47626143564 0.644465752956} H14 23 1 1 {} {0.842386617143 0.6593160723 0.639687726436} H15 24 1 1 {} {0.600163127024 0.505598184429 0.67909202316} H16 25 1 1 {} {0.740126548106 0.450926803876 0.763080471133} H17 26 1 1 {} {0.659220297888 0.320205648113 0.645726010779} H18 27 1 1 {} {0.570853453472 0.376513740956 0.384869433375} H19 28 1 1 {} {0.547973880206 0.50756108588 0.426951851955} H20 29 1 @end @Columns Cell Constraints string {a b c A B G} Origin int {{0 0 0}} Parameters double {{10.0 10.0 10.0 90.0 90.0 90.0}} PrimitiveData double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} RotationMatrix double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} SpaceGroup string P1 SpaceGroupNumber int 1 ToCartesians double {{{10.0 0.0 0.0} {0.0 10.0 0.0} {0.0 0.0 10.0}}} ToFractionals double {{{0.10000000000000001 0.0 0.0} {0.0 0.10000000000000001 0.0} {0.0 0.0 0.10000000000000001}}} @end @data {a b c A B G} {0 0 0} {15 12 12 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{15 0 0} {0 12 0} {0 0 12}} {{0.0666666666667 0 0} {0 0.0833333333333 0} {0 0 0.0833333333333}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 27 18 0 0 2 0 0 0 15 14 0 0 10 3 0 0 6 1 0 0 26 17 0 0 7 2 0 0 8 2 0 0 21 16 0 0 28 18 0 0 9 2 0 0 20 15 0 0 19 15 0 0 1 0 0 0 4 1 0 0 5 1 0 0 25 17 0 0 18 15 0 0 13 4 0 0 3 0 0 0 16 14 0 0 17 14 0 0 12 3 0 0 24 17 0 0 23 16 0 0 11 3 0 0 22 16 0 0 @end @Columns Bond AsymmetricBond reference AsymmetricBond Atom1 reference Atom Atom2 reference Atom CellOffset2 int {{0 0 0}} Key int 0 @end @data 0 27 18 {0 0 0} 0 1 0 2 {0 0 0} 0 2 14 15 {0 0 0} 0 3 3 10 {0 0 0} 0 4 1 6 {0 0 0} 0 5 26 17 {0 0 0} 0 6 7 2 {0 0 0} 0 7 8 2 {0 0 0} 0 8 16 21 {0 0 0} 0 9 28 18 {0 0 0} 0 10 9 2 {0 0 0} 0 11 15 20 {0 0 0} 0 12 15 19 {0 0 0} 0 13 0 1 {0 0 0} 0 14 4 1 {0 0 0} 0 15 1 5 {0 0 0} 0 16 17 25 {0 0 0} 0 17 15 18 {0 0 0} 0 18 4 13 {0 0 0} 0 19 3 0 {0 0 0} 0 20 16 14 {0 0 0} 0 21 14 17 {0 0 0} 0 22 3 12 {0 0 0} 0 23 17 24 {0 0 0} 0 24 16 23 {0 0 0} 0 25 11 3 {0 0 0} 0 26 22 16 {0 0 0} 0 @end @Columns Subset Color string {{#65d9f0}} Criteria string {{}} DisplayLine int 0 IeqJ int 1 IgtJ int 0 IltJ int 0 Length int 1 Name string {{}} Table string {{}} Type string atom UseColor int 0 @end @data @end